5-phenyl-4-[(4-propan-2-ylpiperazin-1-yl)carbonylamino]pentanethioate

Systemtic Name: 5-phenyl-4-[(4-propan-2-ylpiperazin-1-yl)carbonylamino]pentanethioate Openeye Name: 4-[(4-isopropylpiperazine-1-carbonyl)amino]-5-phenyl-pentanethioate CAS Name: 4-[[oxo-(4-propan-2-yl-1-piperazinyl)methyl]amino]-5-phenylpentanethioate IUPAC Name: 5-phenyl-4-[(4-propan-2-ylpiperazine-1-carbonyl)amino]pentanethioate Traditional Name: 4-[(4-isopropylpiperazine-1-carbonyl)amino]-5-phenyl-thiovalerate Formula: C19H28N3O2S- MolecularWeight: 362.50952

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1CCN(CC1)C(=O)NC(CCC(=S)[O-])CC2=CC=CC=C2

Isomeric SMILES

CC(C)N1CCN(CC1)C(=O)NC(CCC(=S)[O-])CC2=CC=CC=C2

InChI

InChI=1S/C19H29N3O2S/c1-15(2)21-10-12-22(13-11-21)19(24)20-17(8-9-18(23)25)14-16-6-4-3-5-7-16/h3-7,15,17H,8-14H2,1-2H3,(H,20,24)(H,23,25)/p-1